SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3me5'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD Dali
Z-score
Seq.
Identity (%)
View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HK1_A_T44A3004_1
(SERUM ALBUMIN)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 6 PHE A  87
GLU A 451
LEU A 450
MET A 220
None
0.98A 1hk1A-3me5A:
undetectable
1hk1A-3me5A:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HK3_A_T44A3004_1
(SERUM ALBUMIN)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 7 PHE A  87
GLU A 451
LEU A 450
MET A 220
None
1.00A 1hk3A-3me5A:
undetectable
1hk3A-3me5A:
21.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1HMY_A_SAMA328_0
(HAEIII
METHYLTRANSFERASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 8 PHE A  93
GLU A 115
ILE A 141
PRO A 176
LEU A 205
None
0.56A 1hmyA-3me5A:
27.8
1hmyA-3me5A:
30.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LQT_B_ACTB1873_0
(FPRA)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 ASP A 293
ASP A 298
LYS A 453
None
0.93A 1lqtB-3me5A:
3.3
1lqtB-3me5A:
24.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LQU_B_ACTB1430_0
(FPRA)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 ASP A 293
ASP A 298
LYS A 453
None
0.90A 1lquB-3me5A:
2.8
1lquB-3me5A:
24.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RD7_B_FOLB361_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 ILE A 213
THR A 145
ILE A 141
ILE A 212
THR A 244
None
1.03A 1rd7B-3me5A:
undetectable
1rd7B-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RE7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 ILE A 213
THR A 145
ILE A 141
ILE A 212
THR A 244
None
1.00A 1re7A-3me5A:
undetectable
1re7A-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1SKX_A_RFPA1_1
(ORPHAN NUCLEAR
RECEPTOR PXR)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 LEU A 172
PHE A 137
HIS A 128
ARG A 101
PHE A  89
None
1.37A 1skxA-3me5A:
undetectable
1skxA-3me5A:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TT0_A_ACTA4901_0
(PYRANOSE OXIDASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 6 THR A 237
PHE A 180
PHE A 175
ASN A 225
None
1.49A 1tt0A-3me5A:
undetectable
1tt0A-3me5A:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TT0_C_ACTC6901_0
(PYRANOSE OXIDASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 6 THR A 237
PHE A 180
PHE A 175
ASN A 225
None
1.50A 1tt0C-3me5A:
2.5
1tt0C-3me5A:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TT0_D_ACTD5901_0
(PYRANOSE OXIDASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 6 THR A 237
PHE A 180
PHE A 175
ASN A 225
None
1.50A 1tt0D-3me5A:
2.4
1tt0D-3me5A:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2D0K_B_FOLB2161_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.25A 2d0kB-3me5A:
undetectable
2d0kB-3me5A:
17.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2HMY_B_SAMB328_0
(PROTEIN
(CYTOSINE-SPECIFIC
METHYLTRANSFERASE
HHAI))
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
7 / 12 PHE A  93
GLY A  95
GLY A  98
ASP A 140
ILE A 141
PRO A 176
VAL A 438
None
0.96A 2hmyB-3me5A:
27.8
2hmyB-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2HMY_B_SAMB328_0
(PROTEIN
(CYTOSINE-SPECIFIC
METHYLTRANSFERASE
HHAI))
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
7 / 12 PHE A  93
GLY A  95
GLY A  98
ILE A 141
PRO A 176
LEU A 205
VAL A 438
None
0.55A 2hmyB-3me5A:
27.8
2hmyB-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2HMY_B_SAMB328_0
(PROTEIN
(CYTOSINE-SPECIFIC
METHYLTRANSFERASE
HHAI))
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A  93
GLY A  97
ILE A 141
PRO A 176
LEU A 205
None
0.83A 2hmyB-3me5A:
27.8
2hmyB-3me5A:
30.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J9D_A_ACTA1117_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 ASP A 377
ARG A 400
ARG A 378
None
1.04A 2j9dA-3me5A:
undetectable
2j9dC-3me5A:
undetectable
2j9dA-3me5A:
13.07
2j9dC-3me5A:
13.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JJ8_C_AZZC1211_1
(DEOXYNUCLEOSIDE
KINASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 ILE A 266
VAL A 282
LEU A 450
PHE A 103
PHE A 443
None
1.20A 2jj8C-3me5A:
undetectable
2jj8C-3me5A:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2LH8_A_VIBA1_1
(MAJOR PRION PROTEIN)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 6 PRO A 218
MET A 220
ASP A 251
TYR A 250
None
1.45A 2lh8A-3me5A:
undetectable
2lh8A-3me5A:
13.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q63_A_1UNA1001_2
(PROTEASE RETROPEPSIN)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 ARG A 405
ASN A 436
THR A 123
None
0.82A 2q63A-3me5A:
undetectable
2q63A-3me5A:
11.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A 137
ILE A  27
PHE A 421
PHE A 413
ALA A  94
None
1.22A 3apwA-3me5A:
undetectable
3apwA-3me5A:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AV6_A_SAMA1_0
(DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 PHE A  93
GLY A  95
GLY A  98
LEU A 205
ASN A 436
VAL A 438
None
0.72A 3av6A-3me5A:
12.3
3av6A-3me5A:
15.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AV6_A_SAMA1_0
(DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 PHE A  93
GLY A  95
GLY A  98
PRO A 176
LEU A 205
VAL A 438
None
0.95A 3av6A-3me5A:
12.3
3av6A-3me5A:
15.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A  93
GLY A  97
ILE A 141
LEU A 205
ASN A 436
None
0.95A 3eeoA-3me5A:
23.7
3eeoA-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A  93
GLY A  97
ILE A 141
PRO A 176
LEU A 205
None
0.98A 3eeoA-3me5A:
23.7
3eeoA-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A  93
GLY A  98
ASP A 140
ILE A 141
ASN A 436
None
1.09A 3eeoA-3me5A:
23.7
3eeoA-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A  93
GLY A  98
ILE A 141
LEU A 205
ASN A 436
None
0.69A 3eeoA-3me5A:
23.7
3eeoA-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A  93
GLY A  98
ILE A 141
PRO A 176
LEU A 205
None
0.64A 3eeoA-3me5A:
23.7
3eeoA-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3EEO_A_SAMA328_1
(MODIFICATION
METHYLASE HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 GLU A 115
SER A 437
VAL A 438
None
0.33A 3eeoA-3me5A:
26.8
3eeoA-3me5A:
30.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KP6_B_SALB3006_1
(TRANSCRIPTIONAL
REGULATOR TCAR)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 6 ASN A  43
ILE A  49
GLU A  67
ASN A  38
None
1.32A 3kp6A-3me5A:
undetectable
3kp6B-3me5A:
undetectable
3kp6A-3me5A:
18.58
3kp6B-3me5A:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TMZ_A_06XA504_1
(CYTOCHROME P450 2B4)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 9 LEU A 281
ILE A  90
PHE A 206
GLU A 224
VAL A 209
None
1.46A 3tmzA-3me5A:
undetectable
3tmzA-3me5A:
23.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D33_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 5 GLY A  97
ILE A  96
VAL A 440
SER A 437
None
1.17A 4d33A-3me5A:
undetectable
4d33A-3me5A:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D33_B_ACTB860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 5 GLY A  97
ILE A  96
VAL A 440
SER A 437
None
1.19A 4d33B-3me5A:
undetectable
4d33B-3me5A:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EAT_A_BEZA1000_0
(BENZOATE-COENZYME A
LIGASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 7 TYR A 124
ALA A  94
GLY A  95
ILE A  99
GLY A  98
None
1.35A 4eatA-3me5A:
2.4
4eatA-3me5A:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EJJ_C_NCTC501_1
(CYTOCHROME P450 2A6)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 5 PHE A 434
PHE A 421
ILE A  96
GLY A  97
None
0.95A 4ejjC-3me5A:
undetectable
4ejjC-3me5A:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FGL_D_CLQD303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 6 GLY A 107
GLY A 108
GLU A 451
ILE A 454
None
0.94A 4fglD-3me5A:
3.9
4fglD-3me5A:
18.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FHB_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.23A 4fhbA-3me5A:
undetectable
4fhbA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FUB_A_ACTA311_0
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 TYR A 129
ARG A 100
HIS A 135
None
1.25A 4fubA-3me5A:
undetectable
4fubA-3me5A:
18.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KJL_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.25A 4kjlA-3me5A:
undetectable
4kjlA-3me5A:
17.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MWZ_B_CQAB303_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 8 GLY A 371
LEU A 314
LEU A 313
GLU A 406
None
0.82A 4mwzB-3me5A:
undetectable
4mwzB-3me5A:
18.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PTH_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.20A 4pthA-3me5A:
undetectable
4pthA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PTJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 ILE A 213
THR A 145
ILE A 141
ILE A 212
THR A 244
None
1.06A 4ptjA-3me5A:
undetectable
4ptjA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QYQ_A_3CJA607_1
(LACTOPEROXIDASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 GLN A 149
HIS A 148
ARG A 142
None
1.29A 4qyqA-3me5A:
undetectable
4qyqA-3me5A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X5G_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.19A 4x5gB-3me5A:
undetectable
4x5gB-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X5I_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.10A 4x5iA-3me5A:
undetectable
4x5iA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X5J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 ILE A 213
THR A 145
ILE A 141
ILE A 212
THR A 244
None
0.97A 4x5jA-3me5A:
undetectable
4x5jA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5E8Q_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 ILE A 213
THR A 145
ILE A 141
ILE A 212
THR A 244
None
0.98A 5e8qA-3me5A:
undetectable
5e8qA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EAJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.18A 5eajA-3me5A:
undetectable
5eajA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HJI_A_ADNA401_1
(TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5A)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 11 PHE A  93
GLY A  95
GLU A 115
ASN A 117
PRO A 176
None
0.70A 5hjiA-3me5A:
8.4
5hjiA-3me5A:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N9X_A_THRA601_0
(ADENYLATION DOMAIN)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
4 / 7 PHE A  89
ASP A  91
GLY A 102
GLY A  98
None
1.02A 5n9xA-3me5A:
3.3
5n9xA-3me5A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TRQ_B_ACTB307_0
(WELO5)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
3 / 3 GLU A  67
HIS A  70
VAL A  40
None
0.81A 5trqB-3me5A:
undetectable
5trqB-3me5A:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UJX_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.19A 5ujxA-3me5A:
undetectable
5ujxA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z6J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.22A 5z6jA-3me5A:
undetectable
5z6jA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
6 / 12 ILE A 213
THR A 145
ILE A 141
LEU A  92
ILE A 212
THR A 244
None
1.22A 5z6kA-3me5A:
undetectable
5z6kA-3me5A:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EBP_B_DAHB123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 10 PHE A 103
SER A 105
GLY A 107
ILE A 106
PHE A  87
None
1.11A 6ebpB-3me5A:
undetectable
6ebpB-3me5A:
10.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EBP_C_DAHC123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 10 PHE A 103
SER A 105
GLY A 107
ILE A 106
PHE A  87
None
1.12A 6ebpC-3me5A:
undetectable
6ebpC-3me5A:
10.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EBP_D_DAHD123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 10 PHE A 103
SER A 105
GLY A 107
ILE A 106
PHE A  87
None
1.10A 6ebpD-3me5A:
undetectable
6ebpD-3me5A:
10.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GP2_B_DAHB126_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA CHAIN)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 11 PHE A 103
SER A 105
GLY A 107
ILE A 106
PHE A  87
None
1.06A 6gp2B-3me5A:
undetectable
6gp2B-3me5A:
9.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6MHT_D_SAMD328_0
(CYTOSINE-SPECIFIC
METHYLTRANSFERASE
HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
8 / 12 PHE A  93
GLY A  95
GLY A  98
ASP A 140
ILE A 141
ASN A 436
SER A 437
VAL A 438
None
0.87A 6mhtA-3me5A:
25.4
6mhtA-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6MHT_D_SAMD328_0
(CYTOSINE-SPECIFIC
METHYLTRANSFERASE
HHAI)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 PHE A  93
GLY A  97
ILE A 141
ASN A 436
SER A 437
None
1.06A 6mhtA-3me5A:
25.4
6mhtA-3me5A:
30.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
7DFR_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri)
5 / 12 ILE A 213
THR A 145
ILE A 141
ILE A 212
THR A 244
None
1.01A 7dfrA-3me5A:
undetectable
7dfrA-3me5A:
17.58